3-(2-methylphenyl)-5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-(2-methylphenyl)-5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-(o-tolyl)-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-(2-methylphenyl)-5-[(4-methylphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-(2-methylphenyl)-5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(4-methylbenzyl)thio]-5-(o-tolyl)-1,2,4-triazole Formula: C20H21N3S MolecularWeight: 335.46584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)C3=CC=CC=C3C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)C3=CC=CC=C3C

InChI

InChI=1S/C20H21N3S/c1-4-13-23-19(18-8-6-5-7-16(18)3)21-22-20(23)24-14-17-11-9-15(2)10-12-17/h4-12H,1,13-14H2,2-3H3